SCHEMBL28069604

SCHEMBL28069604

NNc1cccc(N)c1[N+](=O)[O-]

nearest known ligand 0.44

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 4/20 0.41
TDP1 Q9NUW8 2/20 0.41
MAPT P10636 4/20 0.41
KAT2B Q92831 1/20 0.39
KMT2A Q03164 4/20 0.38
MEN1 O00255 3/20 0.38
USP2 O75604 1/20 0.38
KEAP1 Q14145 1/20 0.38
NFE2L2 Q16236 1/20 0.38
POLB P06746 1/20 0.36
BCL6 P41182 1/20 0.36
BCOR Q6W2J9 1/20 0.36
TSHR P16473 2/20 0.36
GPR35 Q9HC97 1/20 0.36
PDE7A Q13946 2/20 0.36
CA9 Q16790 1/20 0.36
SMN1; SMN2 Q16637 1/20 0.36
GFER P55789 1/20 0.36
RORC P51449 1/20 0.35
LMNA P02545 1/20 0.34

Click a target to see other patent compounds predicted against it — the reverse direction, in place.

Similar compounds — the chemically nearest patent molecules

Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.

Compoundsimilaritytop predictedshared targets
SCHEMBL9771571 0.83 KAT2B (0.44) ALDH1A1TDP1MAPTKAT2BKMT2A
SCHEMBL3390153 0.81 TDP1 (0.52) ALDH1A1TDP1MAPTKMT2AMEN1
SCHEMBL11551067 0.81 TDP1 (0.52) ALDH1A1TDP1MAPTKMT2AMEN1
SCHEMBL38001 0.81 GPR35 (0.53) ALDH1A1TDP1MAPTKAT2BKMT2A
SCHEMBL30426811 0.81 GPR35 (0.53) ALDH1A1TDP1MAPTKAT2BKMT2A
SCHEMBL2958662 0.79 KAT2B (0.41) ALDH1A1TDP1MAPTKAT2BKMT2A
SCHEMBL11789633 0.79 ALDH1A1 (0.41) ALDH1A1TDP1MAPTKAT2BKMT2A
Hydrochloric Acid SCHEMBL1511024 0.79 GPR35 (0.52) ALDH1A1TDP1MAPTKAT2BKMT2A
Hydrochloric Acid SCHEMBL5914596 0.79 TDP1 (0.50) ALDH1A1TDP1MAPTKMT2AMEN1
SCHEMBL10580754 0.77 ERN1 (0.45) ALDH1A1TDP1MAPTKAT2BKMT2A

Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.

Patent provenance — the patents this molecule appears in, and who filed them

Claimed or disclosed in 6 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-107523996-A A kind of anti-oxidant xanthochromia finishing agent and preparation method thereof 南通冠洲国际贸易有限公司 2017-12-29 CN claimed
CN-105648759-A Anti-oxidation finishing agent for textiles and preparation method of anti-oxidation finishing agent 吴江市泽旺纺织有限公司 2016-06-08 CN claimed
CN-108468211-B Anti-yellowing agent and preparation method thereof 江苏宇道生物科技有限公司 2020-04-28 CN disclosed
CN-108468211-A A kind of novel anti-yellowing agent and preparation method thereof 江苏宇道生物科技有限公司 2018-08-31 CN disclosed
CN-107523996-A A kind of anti-oxidant xanthochromia finishing agent and preparation method thereof 南通冠洲国际贸易有限公司 2017-12-29 CN disclosed
CN-105648759-A Anti-oxidation finishing agent for textiles and preparation method of anti-oxidation finishing agent 吴江市泽旺纺织有限公司 2016-06-08 CN disclosed